N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide

C15H18N2O2 — CID 110415002

IUPACN-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide
SMILESCC(=O)NCCc1nc(-c2ccc(C)cc2)oc1C
InChIInChI=1S/C15H18N2O2/c1-10-4-6-13(7-5-10)15-17-14(11(2)19-15)8-9-16-12(3)18/h4-7H,8-9H2,1-3H3,(H,16,18)
InChIKeyWDIDGXOYJLIHGA-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.64
Rot. Bonds4

About N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide

N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide (PubChem CID 110415002) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide
PubChem CID110415002
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide
SMILESCC(=O)NCCc1nc(-c2ccc(C)cc2)oc1C
InChIInChI=1S/C15H18N2O2/c1-10-4-6-13(7-5-10)15-17-14(11(2)19-15)8-9-16-12(3)18/h4-7H,8-9H2,1-3H3,(H,16,18)
InChIKeyWDIDGXOYJLIHGA-UHFFFAOYSA-N
XLogP2.64
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide?
The IUPAC name of N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide (CID 110415002) is N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide is CC(=O)NCCc1nc(-c2ccc(C)cc2)oc1C.
What is the InChIKey of N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide?
The InChIKey is WDIDGXOYJLIHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10-4-6-13(7-5-10)15-17-14(11(2)19-15)8-9-16-12(3)18/h4-7H,8-9H2,1-3H3,(H,16,18).
What are the key properties of N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide?
N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethyl]acetamide is sourced from PubChem (CID 110415002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).